colabfit/mlearn_Si_train
收藏Hugging Face2025-04-01 更新2025-04-12 收录
下载链接：
https://hf-mirror.com/datasets/colabfit/mlearn_Si_train
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资源简介：
mlearn Si train数据集是一个包含硅元素配置的综合DFT数据集，特别针对硅元素，包含了214个独特的分子配置和13233个原子。数据集包括能量、原子力和Cauchy应力等属性。
The mlearn Si train dataset is a comprehensive DFT dataset containing configurations specifically for the silicon element, including 214 unique molecular configurations and 13,233 atoms. The dataset includes properties such as energy, atomic forces, and Cauchy stress.
提供机构：
colabfit
